SCHEMBL311399

SCHEMBL311399

CC(C)(C)OC(=O)N1CCC(C(=O)N(CC=O)c2ccc(C(F)(F)F)c(F)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.47
PTPRB P23467 1/20 0.44
PTPN11 Q06124 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
STS P08842 5/20 0.42
SFRP1 Q8N474 2/20 0.41
PTPN2 P17706 1/20 0.41
PTPN1 P18031 1/20 0.41
PTPN6 P29350 1/20 0.41
DPP4 P27487 1/20 0.41
GPR119 Q8TDV5 3/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2063007 0.93 EPHX2 (0.47) EPHX2PTPRBPTPN11MEN1KMT2A
SCHEMBL15732621 0.87 EPHX2 (0.40) EPHX2
SCHEMBL11904712 0.87 PTPRB (0.45) PTPRBPTPN11MEN1KMT2ASTS
SCHEMBL311398 0.73 EPHX2 (0.57) EPHX2KMT2ASTSSFRP1PTPN2
SCHEMBL3397674 0.73 PTPRB (0.48) PTPRBPTPN11MEN1KMT2ASTS
SCHEMBL22265776 0.72 GPR119 (0.66) EPHX2GPR119
SCHEMBL1471050 0.72 PDK2 (0.55) MEN1KMT2AGPR119
SCHEMBL21723196 0.71 KMT2A (0.52) EPHX2MEN1KMT2ASTSPTPN2
SCHEMBL2340961 0.71 PTPRB (0.52) PTPRBPTPN11MEN1KMT2ASTS
SCHEMBL10159468 0.71 MEN1 (0.62) MEN1KMT2ASTSGPR119

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2148880-B1 P70 S6 KINASE INHIBITORS LILLY CO ELI (US) 2014-05-28 EP disclosed
US-20120071490-A1 P70 S6 KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2012-03-22 US disclosed
US-8093383-B2 P70 S6 kinase inhibitors ELI LILLY AND COMPANY (US) 2012-01-10 US disclosed
US-20090163714-A1 P70 S6 KINASE INHIBITORS ELI LILLY AND COMPANY 2009-06-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090163714-A1 P70 S6 KINASE INHIBITORS RPS6KA6, RPS6KA1, RPS6KA2 EPHX2 4803/4885PTPRB 1534/4885PTPN11 973/4885
US-20120071490-A1 P70 S6 KINASE INHIBITORS RPS6KA6, RPS6KA1, RPS6KA2 EPHX2 4803/4885PTPRB 1534/4885PTPN11 973/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.